UCSF

ZINC00810970

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2005 15 Yes

Popular Name: 5-(4-Hydroxy-phenyl)-isoxazole-3-carboxylic acid 5-(4-Hydroxy-phenyl)-isoxazole-3…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 26378-53-0 , 33282-15-4

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.67 2.9 -47.21 1 5 -1 86 204.161 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )